ELPH SELFEN CARRIER DEN - Revision history

Miranda.henrique at 06:55, 24 April 2025

2025-04-24T06:55:35Z

← Older revision		Revision as of 06:55, 24 April 2025
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	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>cm^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.
	{{Available\|6.5.0}}		{{Available\|6.5.0}}

Mani: Add accumulator links

2025-02-28T08:25:56Z

Add accumulator links

← Older revision		Revision as of 08:25, 28 February 2025
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	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron~~-phonon~~ self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the phonon-mediated electron self-energy and transport coefficients.
	{{Available\|6.5.0}}		{{Available\|6.5.0}}

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	----------------------------		----------------------------

	~~The~~ number of elements in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} determines the number of columns, the number of elements in {{TAG\|ELPH_SELFEN_TEMPS}} the number of rows in ~~the tables above~~.		In the above tables, the number of elements in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} determines the number of columns, while the number of elements in {{TAG\|ELPH_SELFEN_TEMPS}} determines the number of rows.
			Specifying more than one carrier density in {{TAG\|ELPH_SELFEN_CARRIER_DEN}} creates additional [[Electron-phonon accumulators \| electron-phonon accumulators]].

	Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential directly and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.
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	==Related tags and articles==		==Related tags and articles==
	* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]		* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]
			* [[Electron-phonon accumulators]]
	* {{TAG\|ELPH_RUN}}		* {{TAG\|ELPH_RUN}}
	* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}		* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}

Mani: Add availability notice

2025-01-17T14:24:27Z

Add availability notice

← Older revision		Revision as of 14:24, 17 January 2025
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	Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.
			{{Available\|6.5.0}}

	----		----

Mani: Add related info and categories

2024-12-19T15:14:17Z

Add related info and categories

← Older revision		Revision as of 15:14, 19 December 2024
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	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: ~~list~~ of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.		Description: List of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.

	----		----
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	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.

			==Related tags and articles==
			* [[Transport coefficients including electron-phonon scattering\|Transport calculations]]
			* {{TAG\|ELPH_RUN}}
			* {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}}
			* {{TAG\|ELPH_SELFEN_MU}}
			* {{TAG\|ELPH_SELFEN_TEMPS}}
			* {{TAG\|NELECT}}

			[[Category:INCAR tag]][[Category:Electron-phonon_interactions]]

Mani: Remove elph release banner

2024-12-18T14:28:19Z

Remove elph release banner

← Older revision		Revision as of 14:28, 18 December 2024
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	~~{{elph_release}}~~
	{{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}}		{{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}}
	{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

Miranda.henrique at 10:54, 18 October 2024

2024-10-18T10:54:50Z

@@ Line 9: / Line 9: @@
 From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG|ELPH_SELFEN_TEMPS}}.
-Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG|ELPH_SELFEN_MU}}.
+For example, if {{TAGO|ELPH_SELFEN_CARRIER_DEN|1e+16 1e+17 1e+18}} the <tt>Chemical potential</tt> section in the {{FILE|OUTCAR}} file might show something like
 The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE|OUTCAR}}.

Miranda.henrique: Undo revision 27136 by Miranda.henrique (talk)

2024-10-18T09:16:03Z

Undo revision 27136 by Miranda.henrique (talk)

← Older revision		Revision as of 09:16, 18 October 2024
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	{{elph_release}}		{{elph_release}}
	{{DISPLAYTITLE:~~ELPH_SELFEN_CARRIER_PER_CELL~~}}		{{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}}
	{{TAGDEF\|~~ELPH_SELFEN_CARRIER_PER_CELL~~\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_DEN\|[real array]\|0.0}}

	Description: list of additional ~~number~~ of ~~carriers~~ at which to compute the electron-phonon self-energy and transport coefficients.		Description: list of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.

	----		----

	~~Each number of carriers~~ specified in the array is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.		From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.
	~~A positive number adds electrons (electron doping), while a negative one removes (hole doping)~~.

	Instead of specifying ~~the number of carriers~~, it is possible to specify an additional ~~carrier density in units~~ of ~~<math>{m^{-3}}</math>~~ by using the {{TAG\|~~ELPH_SELFEN_CARRIER_DEN~~}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG\|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.

Miranda.henrique at 08:52, 18 October 2024

2024-10-18T08:52:15Z

← Older revision		Revision as of 08:52, 18 October 2024
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	{{elph_release}}		{{elph_release}}
	{{DISPLAYTITLE:~~ELPH_SELFEN_CARRIER_DEN~~}}		{{DISPLAYTITLE:ELPH_SELFEN_CARRIER_PER_CELL}}
	{{TAGDEF\|~~ELPH_SELFEN_CARRIER_DEN~~\|[real array]\|0.0}}		{{TAGDEF\|ELPH_SELFEN_CARRIER_PER_CELL\|[real array]\|0.0}}

	Description: list of additional ~~carrier densities in units~~ of ~~<math>m^{-3}</math>~~ at which to compute the electron-phonon self-energy and transport coefficients.		Description: list of additional number of carriers at which to compute the electron-phonon self-energy and transport coefficients.

	----		----

	~~From each carrier density~~ specified in the array~~, a positive (electron doping) or negative (hole doping) number of electrons~~ is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.		Each number of carriers specified in the array is added to the value of {{TAG\|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG\|ELPH_SELFEN_TEMPS}}.
			A positive number adds electrons (electron doping), while a negative one removes (hole doping).

	Instead of specifying ~~a carrier density~~, it is possible to ~~explicitly~~ specify ~~the~~ additional ~~number~~ of ~~electrons to be added~~ by using the {{TAG\|~~ELPH_SELFEN_CARRIER_PER_CELL~~}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.		Instead of specifying the number of carriers, it is possible to specify an additional carrier density in units of <math>{m^{-3}}</math> by using the {{TAG\|ELPH_SELFEN_CARRIER_DEN}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG\|ELPH_SELFEN_MU}}.

	The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.		The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE\|OUTCAR}}.

Miranda.henrique: Created page with "{{elph_release}} {{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}} {{TAGDEF|ELPH_SELFEN_CARRIER_DEN|[real array]|0.0}} Description: list of additional carrier densities in units of $m^{-3}$ at which to compute the electron-phonon self-energy and transport coefficients. ---- From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG|NELECT}} and the chemical potential com..."

2024-10-18T08:41:59Z

Created page with "{{elph_release}} {{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}} {{TAGDEF|ELPH_SELFEN_CARRIER_DEN|[real array]|0.0}} Description: list of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients. ---- From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG|NELECT}} and the chemical potential com..."

New page

{{elph_release}}
{{DISPLAYTITLE:ELPH_SELFEN_CARRIER_DEN}}
{{TAGDEF|ELPH_SELFEN_CARRIER_DEN|[real array]|0.0}}

Description: list of additional carrier densities in units of <math>m^{-3}</math> at which to compute the electron-phonon self-energy and transport coefficients.

----

From each carrier density specified in the array, a positive (electron doping) or negative (hole doping) number of electrons is added to the value of {{TAG|NELECT}} and the chemical potential computed for the list of temperatures specified by {{TAG|ELPH_SELFEN_TEMPS}}.

Instead of specifying a carrier density, it is possible to explicitly specify the additional number of electrons to be added by using the {{TAG|ELPH_SELFEN_CARRIER_PER_CELL}} tag. Alternatively, one can specify the chemical potential and determine the carrier concentration using {{TAG|ELPH_SELFEN_MU}}.

The information related to the chemical potential calculation can be found under the <tt>Chemical potential calculation</tt> section in the {{FILE|OUTCAR}}.